8-[(5-nitrofuran-2-yl)carbonylamino]naphthalene-1,3,5-trisulfonic acid

Systemtic Name: 8-[(5-nitrofuran-2-yl)carbonylamino]naphthalene-1,3,5-trisulfonic acid Openeye Name: 8-[(5-nitrofuran-2-carbonyl)amino]naphthalene-1,3,5-trisulfonic acid CAS Name: 8-[[(5-nitro-2-furanyl)-oxomethyl]amino]naphthalene-1,3,5-trisulfonic acid IUPAC Name: 8-[(5-nitrofuran-2-carbonyl)amino]naphthalene-1,3,5-trisulfonic acid Traditional Name: 8-[(5-nitro-2-furoyl)amino]naphthalene-1,3,5-trisulfonic acid Formula: C15H10N2O13S3 MolecularWeight: 522.4405

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(C=C(C2=C1NC(=O)C3=CC=C(O3)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C2C=C(C=C(C2=C1NC(=O)C3=CC=C(O3)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C15H10N2O13S3/c18-15(10-2-4-13(30-10)17(19)20)16-9-1-3-11(32(24,25)26)8-5-7(31(21,22)23)6-12(14(8)9)33(27,28)29/h1-6H,(H,16,18)(H,21,22,23)(H,24,25,26)(H,27,28,29)